3-[(3,4-dimethylphenyl)carbonyl-phenyl-amino]propanoic acid

Systemtic Name: 3-[(3,4-dimethylphenyl)carbonyl-phenyl-amino]propanoic acid Openeye Name: 3-(N-(3,4-dimethylbenzoyl)anilino)propanoic acid CAS Name: 3-(N-[(3,4-dimethylphenyl)-oxomethyl]anilino)propanoic acid IUPAC Name: 3-(N-(3,4-dimethylbenzoyl)anilino)propanoic acid Traditional Name: 3-(N-(3,4-dimethylbenzoyl)anilino)propionic acid Formula: C18H19NO3 MolecularWeight: 297.34836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CCC(=O)O)C2=CC=CC=C2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CCC(=O)O)C2=CC=CC=C2)C

InChI

InChI=1S/C18H19NO3/c1-13-8-9-15(12-14(13)2)18(22)19(11-10-17(20)21)16-6-4-3-5-7-16/h3-9,12H,10-11H2,1-2H3,(H,20,21)